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N-(2-Fluorophenyl)-N,1-bis-([3-(trifluoromethyl)phenyl]methyl)piperidin-4-amine
SpectraBase Compound ID LQHe4VubLGl
InChI InChI=1S/C27H25F7N2/c28-24-9-1-2-10-25(24)36(18-20-6-4-8-22(16-20)27(32,33)34)23-11-13-35(14-12-23)17-19-5-3-7-21(15-19)26(29,30)31/h1-10,15-16,23H,11-14,17-18H2
InChIKey YYOSHSQPNDHZJE-UHFFFAOYSA-N
Mol Weight 510.5 g/mol
Molecular Formula C27H25F7N2
Exact Mass 510.190596 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GWCnKVSUk7c
Name N-(2-Fluorophenyl)-N,1-bis-([3-(trifluoromethyl)phenyl]methyl)piperidin-4-amine
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 510.190595954 u
Formula C27H25F7N2
InChI InChI=1S/C27H25F7N2/c28-24-9-1-2-10-25(24)36(18-20-6-4-8-22(16-20)27(32,33)34)23-11-13-35(14-12-23)17-19-5-3-7-21(15-19)26(29,30)31/h1-10,15-16,23H,11-14,17-18H2
InChIKey YYOSHSQPNDHZJE-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 510.500 g/mol
Nominal Mass 510 u
Quality 1000
Retention Index 3884
SMILES C=1(N(C2CCN(CC=3C=C(C(F)(F)F)C=CC3)CC2)CC2=CC(C(F)(F)F)=CC=C2)C(=CC=CC1)F
SPLASH splash10-0006-0590000000-1a4b145f432842335640
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Wiley ID DD2024_030445